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4-PHENYLSULFANYLPHENOXYETHYL-TETRAHYDRO-2H-PYRAN-2-YL-ETHER
SpectraBase Compound ID EqiNxL4LFzR
InChI InChI=1S/C19H22O3S/c1-2-6-17(7-3-1)23-18-11-9-16(10-12-18)20-14-15-22-19-8-4-5-13-21-19/h1-3,6-7,9-12,19H,4-5,8,13-15H2
InChIKey HGWTWUJMDRHATO-UHFFFAOYSA-N
Mol Weight 330.44 g/mol
Molecular Formula C19H22O3S
Exact Mass 330.128966 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GOL2noaIiTO
Name 4-PHENYLSULFANYLPHENOXYETHYL-TETRAHYDRO-2H-PYRAN-2-YL-ETHER
Compound Number 113
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22O3S
InChI InChI=1S/C19H22O3S/c1-2-6-17(7-3-1)23-18-11-9-16(10-12-18)20-14-15-22-19-8-4-5-13-21-19/h1-3,6-7,9-12,19H,4-5,8,13-15H2
InChIKey HGWTWUJMDRHATO-UHFFFAOYSA-N
Literature Reference Author E.ELHALEM,B.N.BAILEY,R.DOCAMPO,I.UJVARY,S.H.SZAJNMAN,J.B.ROD RIGUEZ
Literature Reference Citation J.MED.CHEM.,45,3984(2002)
Literature Reference DOI 10.1021/jm0201518
Molecular Weight 330.442 g/mol
Sample ID 65036
Solvent CDCl3